EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:131077 - N-ethyl-3-fluoro-N-[[(2R,3R,4S)-4-(hydroxymethyl)-1-(1-oxopropyl)-3-phenyl-2-azetidinyl]methyl]benzamide

ChEBI IDCHEBI:131077
ChEBI NameN-ethyl-3-fluoro-N-[[(2R,3R,4S)-4-(hydroxymethyl)-1-(1-oxopropyl)-3-phenyl-2-azetidinyl]methyl]benzamide
Stars
DownloadsMolfile
FormulaC23H27FN2O3
Net Charge0
Average Mass398.478
Monoisotopic Mass398.20057
SMILESCCC(=O)N1[C@H](CO)[C@H](c2ccccc2)[C@@H]1CN(CC)C(=O)c1cccc(F)c1
InChIInChI=1S/C23H27FN2O3/c1-3-21(28)26-19(22(20(26)15-27)16-9-6-5-7-10-16)14-25(4-2)23(29)17-11-8-12-18(24)13-17/h5-13,19-20,22,27H,3-4,14-15H2,1-2H3/t19-,20+,22+/m0/s1
InChIKeyIEPBIIJIEGXQRE-TUNNFDKTSA-N
ChEBI Ontology
Outgoing Relation(s)
N-ethyl-3-fluoro-N-[[(2R,3R,4S)-4-(hydroxymethyl)-1-(1-oxopropyl)-3-phenyl-2-azetidinyl]methyl]benzamide (CHEBI:131077) is a azetidines (CHEBI:38777)
N-ethyl-3-fluoro-N-[[(2R,3R,4S)-4-(hydroxymethyl)-1-(1-oxopropyl)-3-phenyl-2-azetidinyl]methyl]benzamide (CHEBI:131077) is a benzenes (CHEBI:22712)
N-ethyl-3-fluoro-N-[[(2R,3R,4S)-4-(hydroxymethyl)-1-(1-oxopropyl)-3-phenyl-2-azetidinyl]methyl]benzamide (CHEBI:131077) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-42625LINCS